6-(4-methyl-1,4-diazepan-1-yl)-N4-(phenylmethyl)pyrimidine-2,4-diamine

Systemtic Name: 6-(4-methyl-1,4-diazepan-1-yl)-N4-(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: N4-benzyl-6-(4-methyl-1,4-diazepan-1-yl)pyrimidine-2,4-diamine CAS Name: 6-(4-methyl-1,4-diazepan-1-yl)-N4-(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-benzyl-6-(4-methyl-1,4-diazepan-1-yl)pyrimidine-2,4-diamine Traditional Name: [2-amino-6-(4-methyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-benzyl-amine Formula: C17H24N6 MolecularWeight: 312.41266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=CC(=NC(=N2)N)NCC3=CC=CC=C3

Isomeric SMILES

CN1CCCN(CC1)C2=CC(=NC(=N2)N)NCC3=CC=CC=C3

InChI

InChI=1S/C17H24N6/c1-22-8-5-9-23(11-10-22)16-12-15(20-17(18)21-16)19-13-14-6-3-2-4-7-14/h2-4,6-7,12H,5,8-11,13H2,1H3,(H3,18,19,20,21)